4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide

C18H21FN2O3S — CID 46651101

IUPAC4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide
SMILESCC(C)C(C)NC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1
InChIInChI=1S/C18H21FN2O3S/c1-12(2)13(3)20-18(22)14-8-10-15(11-9-14)25(23,24)21-17-7-5-4-6-16(17)19/h4-13,21H,1-3H3,(H,20,22)
InChIKeyFMCVIDDDXPZIHV-UHFFFAOYSA-N
MW364.44 g/mol
LogP3.40
Rot. Bonds6

About 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide

4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide (PubChem CID 46651101) has the molecular formula C18H21FN2O3S and a molecular weight of 364.44 g/mol. Its IUPAC name is 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide.

Molecular Properties

Compound Name4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide
PubChem CID46651101
Molecular FormulaC18H21FN2O3S
Molecular Weight364.44 g/mol
Exact Mass364.13
IUPAC Name4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide
SMILESCC(C)C(C)NC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1
InChIInChI=1S/C18H21FN2O3S/c1-12(2)13(3)20-18(22)14-8-10-15(11-9-14)25(23,24)21-17-7-5-4-6-16(17)19/h4-13,21H,1-3H3,(H,20,22)
InChIKeyFMCVIDDDXPZIHV-UHFFFAOYSA-N
XLogP3.40
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.44
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-fluorophenyl)sulfamoyl]-N-[(2R)-3-methylbutan-2-yl]benzamide
CID 40790769
3-[(2-fluorophenyl)sulfamoyl]-N-[(2S)-3-methylbutan-2-yl]benzamide
CID 40790771
N-[cyano-(2-fluorophenyl)methyl]-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 56572373
N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 24592548
N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 55584138
4-[(2-fluorophenyl)sulfamoyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 37064232
3-fluoro-N-[2-[[4-[(2-fluorophenyl)sulfamoyl]benzoyl]amino]ethyl]-4-methylbenzamide
CID 24666950
4-[(2-fluorophenyl)sulfamoyl]-N-(3-phenylpropyl)benzamide
CID 27647283
4-[(2-fluorophenyl)sulfamoyl]-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 55407931
N-cycloheptyl-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 71903641
N-[2-(difluoromethoxy)phenyl]-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 2353818
3-[(2-fluorophenyl)sulfamoyl]-N-(1-hydroxypropan-2-yl)benzamide
CID 78856698

Frequently Asked Questions

What is the IUPAC name of 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide?
The IUPAC name of 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide (CID 46651101) is 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide.
What is the SMILES notation for 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide?
The canonical SMILES for 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide is CC(C)C(C)NC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1.
What is the InChIKey of 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide?
The InChIKey is FMCVIDDDXPZIHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O3S/c1-12(2)13(3)20-18(22)14-8-10-15(11-9-14)25(23,24)21-17-7-5-4-6-16(17)19/h4-13,21H,1-3H3,(H,20,22).
What are the key properties of 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide?
4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide has a molecular weight of 364.44 g/mol, XLogP of 3.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide is sourced from PubChem (CID 46651101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).